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QSAR-based virtual screening: advances and applications in drug discovery
BJ Neves, RC Braga, CC Melo-Filho, JT Moreira-Filho, EN Muratov, ...
Frontiers in pharmacology 9, 1275, 2018
4102018
Chalcone derivatives: promising starting points for drug design
MN Gomes, EN Muratov, M Pereira, JC Peixoto, LP Rosseto, PVL Cravo, ...
Molecules 22 (8), 1210, 2017
3702017
In silico Strategies to Support Fragment-to-Lead Optimization in Drug Discovery
LR de Souza Neto, JT Moreira-Filho, BJ Neves, RLBR Maidana, ...
Frontiers in chemistry 8, 93, 2020
1842020
QSAR-driven design, synthesis and discovery of potent chalcone derivatives with antitubercular activity
MN Gomes, RC Braga, EM Grzelak, BJ Neves, E Muratov, R Ma, LL Klein, ...
European journal of medicinal chemistry 137, 126-138, 2017
1192017
Déjà vu: stimulating open drug discovery for SARS-CoV-2
S Ekins, M Mottin, PRPS Ramos, BKP Sousa, BJ Neves, DH Foil, KM Zorn, ...
Drug discovery today 25 (5), 928-941, 2020
1102020
Natural products as leads in schistosome drug discovery
BJ Neves, CH Andrade, PVL Cravo
Molecules 20 (2), 1872-1903, 2015
962015
Discovery of new anti-schistosomal hits by integration of QSAR-based virtual screening and high content screening
BJ Neves, RF Dantas, MR Senger, CC Melo-Filho, WCG Valente, ...
Journal of medicinal chemistry 59 (15), 7075-7088, 2016
782016
In Silico Repositioning-Chemogenomics Strategy Identifies New Drugs with Potential Activity against Multiple Life Stages of Schistosoma mansoni
BJ Neves, RC Braga, JCB Bezerra, PVL Cravo, CH Andrade
PLoS Neglected Tropical Diseases 9 (1), e3435, 2015
602015
Deep Learning-driven research for drug discovery: Tackling Malaria
BJ Neves, RC Braga, VM Alves, MNN Lima, GC Cassiano, EN Muratov, ...
PLoS computational biology 16 (2), e1007025, 2020
582020
QSAR-Driven Discovery of Novel Chemical Scaffolds Active against Schistosoma mansoni
CC Melo-Filho, RF Dantas, RC Braga, BJ Neves, MR Senger, ...
Journal of chemical information and modeling 56 (7), 1357-1372, 2016
532016
Illustrating and homology modeling the proteins of the Zika virus
S Ekins, J Liebler, BJ Neves, WG Lewis, M Coffee, R Bienstock, ...
F1000Research 5, 2016
502016
Analogues of Marine Guanidine Alkaloids Are in Vitro Effective against Trypanosoma cruzi and Selectively Eliminate Leishmania (L.) infantum Intracellular …
LF Martins, JT Mesquita, EG Pinto, TA Costa-Silva, SET Borborema, ...
Journal of natural products 79 (9), 2202-2210, 2016
412016
Antitrypanosomal activity and evaluation of the mechanism of action of dehydrodieugenol isolated from Nectandra leucantha (Lauraceae) and its methylated derivative against …
SS Grecco, TA Costa-Silva, G Jerz, FS de Sousa, GAA Conserva, ...
Phytomedicine 24, 62-67, 2017
362017
Computer-aided discovery of two novel chalcone-like compounds active and selective against Leishmania infantum
MN Gomes, LM Alcântara, BJ Neves, CC Melo-Filho, LH Freitas-Junior, ...
Bioorganic & medicinal chemistry letters 27 (11), 2459-2464, 2017
332017
Structural insights into a novel anticancer sulfonamide chalcone
JMF Custodio, LJ Michelini, MRC de Castro, WF Vaz, BJ Neves, ...
New Journal of Chemistry 42 (5), 3426-3434, 2018
312018
Discovery of new potential hits of Plasmodium falciparum enoyl-ACP reductase through ligand-and structure-based drug design approaches
BJ Neves, RV Bueno, RC Braga, CH Andrade
Bioorganic & medicinal chemistry letters 23 (8), 2436-2441, 2013
312013
In silico chemogenomics drug repositioning strategies for neglected tropical diseases
CH Andrade, BJ Neves, CC Melo-Filho, J Rodrigues, DC Silva, RC Braga, ...
Current Medicinal Chemistry 26 (23), 4355-4379, 2019
292019
Neolignans from leaves of Nectandra leucantha (Lauraceae) display in vitro antitrypanosomal activity via plasma membrane and mitochondrial damages
SS Grecco, TA Costa-Silva, G Jerz, FS de Sousa, VS Londero, ...
Chemico-biological interactions 277, 55-61, 2017
282017
Dealing with frequent hitters in drug discovery: a multidisciplinary view on the issue of filtering compounds on biological screenings
RF Dantas, TCS Evangelista, BJ Neves, MR Senger, CH Andrade, ...
Expert Opinion on Drug Discovery 14 (12), 1269-1282, 2019
252019
Efficacy of sertraline against Trypanosoma cruzi: an in vitro and in silico study
DD Ferreira, JT Mesquita, TAC Silva, MM Romanelli, DGJ Batista, ...
Journal of Venomous Animals and Toxins including Tropical Diseases 24, 30, 2018
242018
Il sistema al momento non può eseguire l'operazione. Riprova più tardi.
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